Bicyclo[2.2.0]hexa-2,5-diene
- Formula: C6H6
- Molecular weight: 78.1118
- IUPAC Standard InChI: InChI=1S/C6H6/c1-2-6-4-3-5(1)6/h1-6H
- IUPAC Standard InChIKey: CTLSARLLLBZBRV-UHFFFAOYSA-N
- CAS Registry Number: 5649-95-6
- Chemical structure:
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Gas phase ion energetics data
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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled as indicated in comments:
LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi
View reactions leading to C6H6+ (ion structure unspecified)
Ionization energy determinations
| IE (eV) | Method | Reference | Comment |
|---|---|---|---|
| 9.0 ± 0.1 | PE | Bieri, Burger, et al., 1977 | LLK |
| 9.4 ± 0.1 | PE | Bieri, Burger, et al., 1977 | Vertical value; LLK |
| 9.40 | PE | Bieri, Heilbronner, et al., 1976 | Vertical value; LLK |
| 9.4 | PE | Bieri, Heibronner, et al., 1975 | Vertical value; LLK |
References
Go To: Top, Gas phase ion energetics data, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Bieri, Burger, et al., 1977
Bieri, G.; Burger, F.; Heilbronner, E.; Maier, J.P.,
Valence ionization enrgies of hydrocarbons,
Helv. Chim. Acta, 1977, 60, 2213. [all data]
Bieri, Heilbronner, et al., 1976
Bieri, G.; Heilbronner, E.; Kobayashi, T.; Schmelzer, A.; Goldstein, M.J.; Leight, R.S.; Lipton, M.S.,
286. Dewar benzene some of its derivatives. A photoelectron spectroscopic analysis,
Helv. Chim. Acta, 1976, 59, 2657. [all data]
Bieri, Heibronner, et al., 1975
Bieri, G.; Heibronner, E.; Goldstein, M.J.; Leight, R.S.; Lipton, M.S.,
The photoelectron spectrum of dewar benzene,
Tetrahedron Lett., 1975, 8, 581. [all data]
Notes
Go To: Top, Gas phase ion energetics data, References
- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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